Match comparison for N_electrons [step 1112] (match type 24581)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 04-lithium.02-absorbing_boundaries.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.353010052117660e+00 | 3.500000000000000e-07 | 2.353009919526758e+00 | 6.512750973836592e-08 | 2.353010017433755e+00 | 2.003895782642928e-07 | PASS |
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Detailed information
Reference: 2.35301005211766, precision: 0.00000035| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 2.353009817044176e+00 | -2.350734833456158e-07 | -6.716385238446168e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 2.353009854434333e+00 | -1.976833265970868e-07 | -5.648095045631051e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 2.353009886182176e+00 | -1.659354835759075e-07 | -4.741013816454500e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 2.353010006622140e+00 | -4.549552024002423e-08 | -1.299872006857835e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 2.353010217823333e+00 | 1.657056731829698e-07 | 4.734447805227709e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 2.353009854434333e+00 | -1.976833265970868e-07 | -5.648095045631051e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 2.353009886182176e+00 | -1.659354835759075e-07 | -4.741013816454500e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 2.353009910870533e+00 | -1.412471268835702e-07 | -4.035632196673435e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 2.353009973298092e+00 | -7.881956820554592e-08 | -2.251987663015598e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 2.353009932449979e+00 | -1.196676810977237e-07 | -3.419076602792107e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 2.353009817044176e+00 | -2.350734833456158e-07 | -6.716385238446168e-01 | PASS |